SCHEMBL1385576

SCHEMBL1385576

O=C(C=Cc1ccc2ccccc2n1)c1ccc(C(=O)N2CCN(c3cccc(Cl)c3)CC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.59
LMNA P02545 1/20 0.59
POLB P06746 1/20 0.59
MAPK1 P28482 1/20 0.59
SMN1; SMN2 Q16637 4/20 0.56
ALDH1A1 P00352 2/20 0.56
PFKFB3 Q16875 2/20 0.54
HDAC6 Q9UBN7 1/20 0.54
KDM4E B2RXH2 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
HTT P42858 2/20 0.50
TSHR P16473 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1382958 0.88 MAPT (0.51) MAPTSMN1; SMN2ALDH1A1HTTTSHR
SCHEMBL1383882 0.85 PFKFB3 (0.69) MAPTLMNAPOLBMAPK1SMN1; SMN2
SCHEMBL1385574 0.85 TSHR (0.53) MAPTLMNAPOLBMAPK1SMN1; SMN2
SCHEMBL1383634 0.84 SMN1; SMN2 (0.54) MAPTLMNAPOLBMAPK1SMN1; SMN2
SCHEMBL1383158 0.83 SMN1; SMN2 (0.50) MAPTLMNASMN1; SMN2ALDH1A1HTT
SCHEMBL1385626 0.82 PFKFB3 (0.67) MAPTLMNAPOLBMAPK1SMN1; SMN2
SCHEMBL1383933 0.81 HDAC6 (0.62) MAPTLMNAPOLBMAPK1SMN1; SMN2
SCHEMBL1386476 0.81 PFKFB3 (0.62) MAPTLMNAPOLBMAPK1SMN1; SMN2
SCHEMBL1383378 0.81 PFKFB3 (0.65) MAPTLMNAPOLBMAPK1SMN1; SMN2
SCHEMBL5101824 0.79 PFKFB3 (0.62) MAPTLMNAPOLBMAPK1SMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4790704-B2 2011-10-12 JP claimed
US-20080207608-A1 2-Propene-1-Ones As Hsp 70 Inducers TORRENT PHARMACEUTICALS LTD. (IN) 2008-08-28 US claimed
EP-1748987-A2 2-PROPENE-1-ONES AS HSP 70 INDUCERS Torrent Pharmaceuticals Ltd (IN) 2007-02-07 EP claimed
WO-2005097746-A2 2-PROPENE-1-ONES AS HSP 70 INDUCERS TORRENT PHARMACEUTICALS LTD (IN) 2005-10-20 WO claimed
US-20080207608-A1 2-Propene-1-Ones As Hsp 70 Inducers TORRENT PHARMACEUTICALS LTD. (IN) 2008-08-28 US disclosed
EP-1748987-A2 2-PROPENE-1-ONES AS HSP 70 INDUCERS Torrent Pharmaceuticals Ltd (IN) 2007-02-07 EP disclosed
WO-2005097746-A2 2-PROPENE-1-ONES AS HSP 70 INDUCERS TORRENT PHARMACEUTICALS LTD (IN) 2005-10-20 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080207608-A1 2-Propene-1-Ones As Hsp 70 Inducers HSPB1, HSF1, HSPE1 MAPT 71/4885LMNA 3126/4885POLB 2686/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.